Geometry & MOs

Info

ID:

328187

PubChem CID:

126694830

Reduced:

NO3C27H53 (1)

Stoich.:

AB3C27D53 (1)

Weight, g/mol:

607.201827

ΔHf, kcal/mol:

-214.63

Dipole, Da:

3.95

IP(EA), eV:

 -9.58(1.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-amino-N-(2-hydroxyethyl)-3-[[3-[[[3-(2-morpholin-4-ylethoxy)phenyl]-phosphanylmethylidene]amino]phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

CCC[C@H](C(C)COC[C@H](CC1CC1CCCC[C@@H](CO)C(C)C)C(C)C)C(=O)NC

DOS

IR

Vibrations