Geometry & MOs

Info

ID:	157103
PubChem CID:	56422130
Reduced:	O2N3C25H31 (1)
Stoich.:	A2B3C25D31 (1)
Weight, g/mol:	398.123504
ΔH_f, kcal/mol:	-52.95
Dipole, Da:	4.32
IP(EA), eV:	-8.73(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[ethyl(propan-2-yl)amino]-N-[2-(1,3,4-thiadiazol-2-ylsulfanyl)phenyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N2CCCC2)NC(=O)C3CCCN(C3)CC4=CC=CC=C4

DOS

IR

Vibrations