Geometry & MOs

Info

ID:	295713
PubChem CID:	117543337
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-44.3
Dipole, Da:	1.32
IP(EA), eV:	-8.8(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-methoxy-5-propan-2-ylphenyl)-1-methylpyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C2(CCN(C2)C)CO

DOS

IR

Vibrations