Geometry & MOs

Info

ID:	356477
PubChem CID:	127291581
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	357.162332
ΔH_f, kcal/mol:	-87.76
Dipole, Da:	4.02
IP(EA), eV:	-8.68(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyanothiophen-2-yl)-3-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)CC(=O)NC3CCOCC3

DOS

IR

Vibrations