Geometry & MOs

Info

ID:	73602
PubChem CID:	48418720
Reduced:	ClO2N3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	318.151433
ΔH_f, kcal/mol:	-13.36
Dipole, Da:	4.5
IP(EA), eV:	-9.79(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzyl(methyl)amino]-N-(5-butyl-1,3,4-thiadiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1CCC(=O)N2CCCC2C3=CC=NC=C3)Cl

DOS

IR

Vibrations