Geometry & MOs

Info

ID:	363691
PubChem CID:	127313309
Reduced:	O3N5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	378.208947
ΔH_f, kcal/mol:	-86.52
Dipole, Da:	7.22
IP(EA), eV:	-8.68(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-oxoethyl]sulfanyl-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)C(=O)CN3C(=O)C4=CC=CC=C4NC3=O

DOS

IR

Vibrations