Geometry & MOs

Info

ID:	332212
PubChem CID:	127250498
Reduced:	NOC5H5 (4)
Stoich.:	ABC5D5 (4)
Weight, g/mol:	438.169191
ΔH_f, kcal/mol:	-14.61
Dipole, Da:	3.03
IP(EA), eV:	-8.8(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-[4-(quinoline-6-carbonyl)morpholin-2-yl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=NON=C1C(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations