Geometry & MOs

Info

ID:	356412
PubChem CID:	127291485
Reduced:	SO2N3C17H31 (1)
Stoich.:	AB2C3D17E31 (1)
Weight, g/mol:	381.208613
ΔH_f, kcal/mol:	-119.88
Dipole, Da:	3.16
IP(EA), eV:	-8.8(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-1-[3-(2-methylbutanoyl)-1,3-thiazolidine-4-carbonyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C)C(=O)N1CSCC1C(=O)NCCN2CCCC(C2)C

DOS

IR

Vibrations