Geometry & MOs

Info

ID:	35456
PubChem CID:	7979901
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	364.082599
ΔH_f, kcal/mol:	-93.68
Dipole, Da:	2.34
IP(EA), eV:	-9.0(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-chloro-2-nitrophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

C/C=C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C)C

DOS

IR

Vibrations