Geometry & MOs

Info

ID:	339853
PubChem CID:	127261862
Reduced:	ON3C9H12 (2)
Stoich.:	AB3C9D12 (2)
Weight, g/mol:	370.211724
ΔH_f, kcal/mol:	-32.22
Dipole, Da:	5.02
IP(EA), eV:	-8.8(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2S)-2-aminopropanoyl]-naphthalen-2-ylamino]-5-(diaminomethylideneamino)pentanamide

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)N([C@@H](CCCN=C(N)N)C(=O)N)C(=O)CN

DOS

IR

Vibrations