Geometry & MOs

Info

ID:	396755
PubChem CID:	135029152
Reduced:	ClOSH7C11 (1)
Stoich.:	ABCD7E11 (1)
Weight, g/mol:	312.136159
ΔH_f, kcal/mol:	3.12
Dipole, Da:	3.62
IP(EA), eV:	-9.17(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10R)-6,7-dimethoxy-10-prop-1-en-2-yl-9,10-dihydrophenanthrene-1,3-diol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2SC(=O)Cl

DOS

IR

Vibrations