Geometry & MOs

Info

ID:	402402
PubChem CID:	135055852
Reduced:	NO4C13H15 (1)
Stoich.:	AB4C13D15 (1)
Weight, g/mol:	421.171165
ΔH_f, kcal/mol:	-59.65
Dipole, Da:	2.26
IP(EA), eV:	-9.65(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-4-methyl-N-[(2S)-1-phenylmethoxybut-3-en-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCOC(=O)C([C@@H](C=C)C1=CC=CC=C1)[N+](=O)[O-]

DOS

IR

Vibrations