Geometry & MOs

Info

ID:	386983
PubChem CID:	134983590
Reduced:	O2C15H16 (1)
Stoich.:	A2B15C16 (1)
Weight, g/mol:	312.136159
ΔH_f, kcal/mol:	-47.52
Dipole, Da:	4.27
IP(EA), eV:	-9.02(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3,4-dimethoxy-9,10-dihydrophenanthren-1-yl)acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC[C@H]3[C@]2(CCC3=O)O

DOS

IR

Vibrations