Geometry & MOs

Info

ID:	237350
PubChem CID:	92718843
Reduced:	N2O3C17H20 (1)
Stoich.:	A2B3C17D20 (1)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-21.89
Dipole, Da:	5.25
IP(EA), eV:	-8.9(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(2,3-dimethyl-5-nitrophenyl)-2-(3-methoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)[C@H](C2=C(C(=CC(=C2)[N+](=O)[O-])C)C)N

DOS

IR

Vibrations