Geometry & MOs

Info

ID:	32427
PubChem CID:	7816684
Reduced:	SO2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	330.121572
ΔH_f, kcal/mol:	-32.53
Dipole, Da:	4.17
IP(EA), eV:	-8.98(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(2-methoxy-4-nitrophenyl)-2-(4-methylphenoxy)propanamide

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@H]1NC(=O)[C@@H](C)SC2=NN=C(N2C)C3=CC=CO3

DOS

IR

Vibrations