Geometry & MOs

Info

ID:	216535
PubChem CID:	85086382
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	278.13068
ΔH_f, kcal/mol:	-159.11
Dipole, Da:	3.03
IP(EA), eV:	-9.83(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(10-acetyl-9,10-dihydrophenanthren-9-yl)propan-2-one

Drug info:

PubChemData

Smile

CC1COC2(C1(CC3(C(C(=O)C=CC3=C2)C)C)O)OC

DOS

IR

Vibrations