Geometry & MOs

Info

ID:	294032
PubChem CID:	117422945
Reduced:	ClNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	267.102606
ΔH_f, kcal/mol:	-29.3
Dipole, Da:	4.29
IP(EA), eV:	-8.57(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-4-(1-methylpyrrolidin-3-yl)oxyphenyl]cyclopropan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1Cl)C2(CC2)N)OCC3CC3

DOS

IR

Vibrations