Geometry & MOs

Info

ID:	237354
PubChem CID:	92718861
Reduced:	NOC9H10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	296.152478
ΔH_f, kcal/mol:	13.63
Dipole, Da:	6.62
IP(EA), eV:	-9.21(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-2,3-dihydro-1H-inden-5-yl-(2,3-dimethyl-5-nitrophenyl)methanamine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)[C@H](C2=CC3=C(CCC3)C=C2)N)[N+](=O)[O-]

DOS

IR

Vibrations