Geometry & MOs

Info

ID:	84172
PubChem CID:	49864736
Reduced:	N2O3C13H26 (1)
Stoich.:	A2B3C13D26 (1)
Weight, g/mol:	381.237604
ΔH_f, kcal/mol:	-174.99
Dipole, Da:	5.22
IP(EA), eV:	-9.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)NC

DOS

IR

Vibrations