Geometry & MOs

Info

ID:	26656
PubChem CID:	794474
Reduced:	NO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	345.147727
ΔH_f, kcal/mol:	-68.48
Dipole, Da:	3.72
IP(EA), eV:	-8.77(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[6-[(3-methylbenzoyl)amino]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NCC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations