Geometry & MOs

Info

ID:	237044
PubChem CID:	92717057
Reduced:	ClOS2N4H15C17 (1)
Stoich.:	ABC2D4E15F17 (1)
Weight, g/mol:	390.037581
ΔH_f, kcal/mol:	57.28
Dipole, Da:	1.47
IP(EA), eV:	-8.76(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[(R)-(4-chlorophenyl)-phenylmethyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](C2=CC=C(C=C2)Cl)NC(=O)CSC3=NN=C(S3)N

DOS

IR

Vibrations