Geometry & MOs

Info

ID:	383990
PubChem CID:	134976126
Reduced:	OF2C10H14 (1)
Stoich.:	AB2C10D14 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-168.97
Dipole, Da:	4.85
IP(EA), eV:	-10.15(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2R)-2-(2-hydroxypropan-2-yl)cyclopropyl]-phenylmethanone

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCC(C2=O)(F)F

DOS

IR

Vibrations