Geometry & MOs

Info

ID:	448559
PubChem CID:	135291851
Reduced:	N2O5C14H28 (1)
Stoich.:	A2B5C14D28 (1)
Weight, g/mol:	465.233582
ΔH_f, kcal/mol:	-252.48
Dipole, Da:	6.52
IP(EA), eV:	-9.66(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-[[2-amino-3-[[(Z)-1-(diaminomethylamino)-2-methyl-3-oxoprop-1-enyl]amino]propyl]amino]benzoyl]amino]pentanedioic acid

Drug info:

PubChemData

Smile

CC(C)NC(=O)CCOCCOCCOCCNC(=O)C

DOS

IR

Vibrations