Geometry & MOs

Info

ID:	362971
PubChem CID:	127309989
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	369.151098
ΔH_f, kcal/mol:	-42.51
Dipole, Da:	4.77
IP(EA), eV:	-8.98(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,2,3,4-tetrahydronaphthalen-2-yl)acetyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2(CCCCC2)NC(=O)CC3CCC4=CC=CC=C4C3

DOS

IR

Vibrations