Geometry & MOs

Info

ID:	356241
PubChem CID:	127291314
Reduced:	O2S2N3C19H29 (1)
Stoich.:	A2B2C3D19E29 (1)
Weight, g/mol:	379.138819
ΔH_f, kcal/mol:	-80.7
Dipole, Da:	2.78
IP(EA), eV:	-8.84(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclobutanecarbonyl)-N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)CC(=O)N1CSCC1C(=O)NCCN2CCC3=C(C2)C=CS3

DOS

IR

Vibrations