Geometry & MOs

Info

ID:	320471
PubChem CID:	126661312
Reduced:	NOSC23H29 (1)
Stoich.:	ABCD23E29 (1)
Weight, g/mol:	355.3239
ΔH_f, kcal/mol:	105.34
Dipole, Da:	2.35
IP(EA), eV:	-9.2(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7Z,10Z,13Z,16Z,19Z)-N-propyldocosa-1,7,10,13,16,19-hexaen-2-amine

Drug info:

PubChemData

Smile

CC/C=C\CC#CCC#CCC#CCC#CCCCCC(=O)NCCS

DOS

IR

Vibrations