Geometry & MOs

Info

ID:	339822
PubChem CID:	127261831
Reduced:	N4O5C12H24 (1)
Stoich.:	A4B5C12D24 (1)
Weight, g/mol:	337.175004
ΔH_f, kcal/mol:	-202.74
Dipole, Da:	7.42
IP(EA), eV:	-9.65(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2,6-diamino-N-[(2S)-1-amino-1-oxopropan-2-yl]-N-(4-nitrophenyl)hexanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)N(C(=O)[C@H](CCCCN)N)O[C@@H](C)C(=O)O

DOS

IR

Vibrations