Geometry & MOs

Info

ID:	276325
PubChem CID:	103822181
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	261.093583
ΔH_f, kcal/mol:	-37.86
Dipole, Da:	8.52
IP(EA), eV:	-8.86(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCCNC1)C(=O)NCC2=CN(C=C2)C

DOS

IR

Vibrations