Geometry & MOs

Info

ID:	293650
PubChem CID:	117395193
Reduced:	ClO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	256.086622
ΔH_f, kcal/mol:	-106.09
Dipole, Da:	5.17
IP(EA), eV:	-8.91(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6-chloro-3,4-dimethoxy-2-methylphenyl)methyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OC)Cl)CC2(CC2)O)OC

DOS

IR

Vibrations