Geometry & MOs

Info

ID:	244596
PubChem CID:	99368112
Reduced:	N5O5C23H27 (1)
Stoich.:	A5B5C23D27 (1)
Weight, g/mol:	414.091725
ΔH_f, kcal/mol:	-135.36
Dipole, Da:	4.31
IP(EA), eV:	-8.63(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)-4-methyl-N-[2-[methyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CN=CC=C1)C(=O)CNC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

DOS

IR

Vibrations