Geometry & MOs

Info

ID:	126614
PubChem CID:	50970265
Reduced:	OSN5C12H13 (1)
Stoich.:	ABC5D12E13 (1)
Weight, g/mol:	361.119319
ΔH_f, kcal/mol:	51.92
Dipole, Da:	4.11
IP(EA), eV:	-9.02(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-acetamido-2-chloro-N-[(2-methoxy-4,6-dimethylpyridin-3-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C1=CN2C=CSC2=N1)NC3=CC(=NC=N3)OC

DOS

IR

Vibrations