Geometry & MOs

Info

ID:	84129
PubChem CID:	49864431
Reduced:	O3N6C14H24 (1)
Stoich.:	A3B6C14D24 (1)
Weight, g/mol:	289.138619
ΔH_f, kcal/mol:	-125.17
Dipole, Da:	6.5
IP(EA), eV:	-9.11(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2S)-2-amino-5-[(2-aminoacetyl)carbamoylamino]pentanoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)N)NC(=O)[C@H](CC1=CN=CN1)NC(=O)CN

DOS

IR

Vibrations