Geometry & MOs

Info

ID:

128223

PubChem CID:

51036375

Reduced:

N4O5H26C27 (1)

Stoich.:

A4B5C26D27 (1)

Weight, g/mol:

576.311184

ΔHf, kcal/mol:

-74.47

Dipole, Da:

13.57

IP(EA), eV:

 -8.51(-1.63)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(3-fluoro-8,8-dimethyl-6-oxo-7,9-dihydropyrido[1,2-a]indol-10-yl)-2-[[4-(2-morpholin-4-ylethoxy)cyclohexyl]amino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1)C2=CC3=C(C=C2)C(CCC3)(C)C)N/N=C\4/C=CC=C(C4=O)C5=COC(=C5)C(=O)O

DOS

IR

Vibrations