Geometry & MOs

Info

ID:	137547
PubChem CID:	52225284
Reduced:	SO2N3C20H27 (1)
Stoich.:	AB2C3D20E27 (1)
Weight, g/mol:	355.153206
ΔH_f, kcal/mol:	-36.02
Dipole, Da:	6.61
IP(EA), eV:	-8.01(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-[methyl-[(4-methylphenyl)methyl]amino]-1-oxopropan-2-yl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)N2CCCCC2)S(=O)(=O)CCC3=CC=CC=N3

DOS

IR

Vibrations