Geometry & MOs

Info

ID:	328412
PubChem CID:	126722939
Reduced:	C5N5H13 (1)
Stoich.:	A5B5C13 (1)
Weight, g/mol:	528.392708
ΔH_f, kcal/mol:	38.44
Dipole, Da:	5.06
IP(EA), eV:	-9.16(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[2-[[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CN(C)C(=NCC(=N)N)N

DOS

IR

Vibrations