Geometry & MOs

Info

ID:	438519
PubChem CID:	135228261
Reduced:	O2N5C10H21 (1)
Stoich.:	A2B5C10D21 (1)
Weight, g/mol:	291.125277
ΔH_f, kcal/mol:	-99.6
Dipole, Da:	6.28
IP(EA), eV:	-9.46(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-4-[[4-methyl-2-(sulfanylamino)pentanoyl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N)NC(=O)CCCCCN=C(N)N

DOS

IR

Vibrations