Geometry & MOs

Info

ID:	286126
PubChem CID:	104153270
Reduced:	N3C16H27 (1)
Stoich.:	A3B16C27 (1)
Weight, g/mol:	247.204848
ΔH_f, kcal/mol:	-16.7
Dipole, Da:	2.79
IP(EA), eV:	-8.16(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,2-dimethylpyrrolidin-1-yl)-6-propylpyridin-4-yl]methanamine

Drug info:

PubChemData

Smile

CC1(CCCN1C2=CC(=CC(=N2)C(C)(C)C)CN)C

DOS

IR

Vibrations