Geometry & MOs

Info

ID:	366666
PubChem CID:	127320195
Reduced:	SO2N4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	350.177647
ΔH_f, kcal/mol:	-21.38
Dipole, Da:	4.18
IP(EA), eV:	-8.81(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclohexylmethylamino)-2-oxoethyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(N(C1)CC(=O)N2CCCC3=CC=CC=C32)C(=O)NC4=NC=CS4

DOS

IR

Vibrations