Geometry & MOs

Info

ID:	295709
PubChem CID:	117543315
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	251.152144
ΔH_f, kcal/mol:	-52.14
Dipole, Da:	2.03
IP(EA), eV:	-8.79(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2,4-dimethoxyphenyl)-1-methylpyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C2(CCN(C2)C)CO

DOS

IR

Vibrations