Geometry & MOs

Info

ID:	17915
PubChem CID:	527377
Reduced:	NC36H71 (1)
Stoich.:	AB36C71 (1)
Weight, g/mol:	517.558651
ΔH_f, kcal/mol:	-137.4
Dipole, Da:	3.69
IP(EA), eV:	-10.21(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

21,25-dimethyltetratriacontanenitrile

Drug info:

PubChemData

Smile

CCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCCCCCCCC#N

DOS

IR

Vibrations