Geometry & MOs

Info

ID:	27111
PubChem CID:	814331
Reduced:	SO2N3C18H27 (1)
Stoich.:	AB2C3D18E27 (1)
Weight, g/mol:	329.119798
ΔH_f, kcal/mol:	-74.09
Dipole, Da:	3.57
IP(EA), eV:	-8.81(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-N-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)CN(CC2CC2)C(=O)C3CCCCC3)C

DOS

IR

Vibrations