Geometry & MOs

Info

ID:	286125
PubChem CID:	104153269
Reduced:	N3C18H31 (1)
Stoich.:	A3B18C31 (1)
Weight, g/mol:	261.220498
ΔH_f, kcal/mol:	-20.22
Dipole, Da:	0.22
IP(EA), eV:	-8.06(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-tert-butyl-6-(2,2-dimethylpyrrolidin-1-yl)pyridin-4-yl]methanamine

Drug info:

PubChemData

Smile

CCNCC1=CC(=NC(=C1)N2CCCC2(C)C)C(C)(C)C

DOS

IR

Vibrations