Geometry & MOs

Info

ID:	307193
PubChem CID:	125275700
Reduced:	ClSN3O3C16H18 (1)
Stoich.:	ABC3D3E16F18 (1)
Weight, g/mol:	287.084081
ΔH_f, kcal/mol:	-94.3
Dipole, Da:	10.71
IP(EA), eV:	-8.64(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R)-2,3-dihydrothiophen-2-yl]-N-[3-(2H-tetrazol-5-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC(=O)[C@H](C(=N2)C)CCO

DOS

IR

Vibrations