Geometry & MOs

Info

ID:	56461
PubChem CID:	17435687
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	367.099063
ΔH_f, kcal/mol:	9.0
Dipole, Da:	6.03
IP(EA), eV:	-8.7(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]methyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(C2=CC=CC=C2)C(=O)NC3=NOC(=C3)C)C

DOS

IR

Vibrations