Geometry & MOs

Info

ID:	435333
PubChem CID:	135191217
Reduced:	N2C14H27 (1)
Stoich.:	A2B14C27 (1)
Weight, g/mol:	187.217424
ΔH_f, kcal/mol:	18.31
Dipole, Da:	1.12
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.008208
Charge, e:	1

Chem-info

IUPAC name:

3-(butylamino)propyl-ethyl-dimethylazanium

Drug info:

PubChemData

Smile

CCNCCC[N+](C)(C)CC1=CCCC=C1

DOS

IR

Vibrations