Geometry & MOs

Info

ID:	14625
PubChem CID:	416362
Reduced:	NOC24H54 (1)
Stoich.:	ABC24D54 (1)
Weight, g/mol:	372.42054
ΔH_f, kcal/mol:	-124.25
Dipole, Da:	2.28
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.750661
Charge, e:	1

Chem-info

IUPAC name:

propan-2-ol;trimethyl(octadecyl)azanium

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC[N+](C)(C)C.CC(C)O

DOS

IR

Vibrations