Geometry & MOs

Info

ID:	64943
PubChem CID:	29204232
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	277.088498
ΔH_f, kcal/mol:	-101.83
Dipole, Da:	5.75
IP(EA), eV:	-9.62(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(pyridin-3-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)NCC1=CN=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations