Geometry & MOs

Info

ID:	303591
PubChem CID:	124489938
Reduced:	NO2C4H7 (3)
Stoich.:	AB2C4D7 (3)
Weight, g/mol:	372.183127
ΔH_f, kcal/mol:	-247.31
Dipole, Da:	6.25
IP(EA), eV:	-9.94(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-6-[5-[(3aR,4S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-2-aminohexanoic acid

Drug info:

PubChemData

Smile

C1CN([C@@H]1C(=O)O)CC[C@@H](C(=O)O)NCC[C@H](C(=O)O)N

DOS

IR

Vibrations