Geometry & MOs

Info

ID:	295703
PubChem CID:	117543042
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	239.107692
ΔH_f, kcal/mol:	-91.6
Dipole, Da:	1.08
IP(EA), eV:	-8.46(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(3-chlorophenyl)methyl]-1-methylpyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC(C)C1=C(C=CC(=C1)CC2(CCNC2)CO)OC

DOS

IR

Vibrations