Geometry & MOs

Info

ID:	56266
PubChem CID:	17422908
Reduced:	OSN4H18C21 (1)
Stoich.:	ABC4D18E21 (1)
Weight, g/mol:	425.177313
ΔH_f, kcal/mol:	73.01
Dipole, Da:	7.16
IP(EA), eV:	-9.0(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N=C(N2)CSC3=NC(=NC4=CC=CC=C43)C5CC5

DOS

IR

Vibrations