Geometry & MOs

Info

ID:	212334
PubChem CID:	81060200
Reduced:	N3C17H25 (1)
Stoich.:	A3B17C25 (1)
Weight, g/mol:	245.152812
ΔH_f, kcal/mol:	5.2
Dipole, Da:	5.66
IP(EA), eV:	-8.97(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(methoxymethyl)pyrrolidin-1-yl]-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1CCC(CC1)CCNC2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations