Geometry & MOs

Info

ID:	39465
PubChem CID:	8140896
Reduced:	SN2O2H22C23 (1)
Stoich.:	AB2C2D22E23 (1)
Weight, g/mol:	312.147393
ΔH_f, kcal/mol:	-34.38
Dipole, Da:	6.1
IP(EA), eV:	-8.81(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-hydroxy-5-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

DOS

IR

Vibrations