Geometry & MOs

Info

ID:	277203
PubChem CID:	103827290
Reduced:	NOC5H10 (2)
Stoich.:	ABC5D10 (2)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-109.93
Dipole, Da:	2.33
IP(EA), eV:	-9.13(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-hydroxy-3-methylpyrrolidin-1-yl)methyl]-4-methoxybenzonitrile

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)N1CCC(C1)(C)O

DOS

IR

Vibrations