Geometry & MOs

Info

ID:	294367
PubChem CID:	117454558
Reduced:	ClO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	282.102272
ΔH_f, kcal/mol:	-118.7
Dipole, Da:	4.78
IP(EA), eV:	-8.91(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[6-chloro-2-(cyclopropylmethoxy)-3-methoxyphenyl]methyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

CC(CC=O)C1=CC2=C(C=C1Cl)OCC(CO2)(C)C

DOS

IR

Vibrations