Geometry & MOs

Info

ID:	392118
PubChem CID:	135013079
Reduced:	INOC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	328.14633
ΔH_f, kcal/mol:	35.87
Dipole, Da:	11.04
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.752867
Charge, e:	0

Chem-info

IUPAC name:

9-(methoxymethyl)-10-(2-methoxyphenyl)phenanthrene

Drug info:

PubChemData

Smile

CC1(C(C([N+]2=CC=CC=C12)C3=CC=CC=C3)I)O

DOS

IR

Vibrations