Geometry & MOs

Info

ID:	243907
PubChem CID:	99300589
Reduced:	SN3O3H21C25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	351.104148
ΔH_f, kcal/mol:	-16.56
Dipole, Da:	5.28
IP(EA), eV:	-8.39(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-phenylbenzamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=C(C=C3)OC)C4=CC=CC=C4

DOS

IR

Vibrations