Geometry & MOs

Info

ID:	237355
PubChem CID:	92718862
Reduced:	NOC9H10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	13.66
Dipole, Da:	6.05
IP(EA), eV:	-9.06(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(R)-(4-butylphenyl)-(3,4-dimethoxyphenyl)methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations