Geometry & MOs

Info

ID:	331019
PubChem CID:	127248426
Reduced:	SN3O4C19H25 (1)
Stoich.:	AB3C4D19E25 (1)
Weight, g/mol:	405.172228
ΔH_f, kcal/mol:	-129.43
Dipole, Da:	3.74
IP(EA), eV:	-9.12(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propan-2-yl-3-[4-(2-propan-2-yloxyacetyl)morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)OCC(=O)N1CCOC(C1)C2=C(SC3=C2C=CC=N3)C(=O)N(C)C

DOS

IR

Vibrations