Geometry & MOs

Info

ID:	146987
PubChem CID:	53776923
Reduced:	SO2N3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	586.220969
ΔH_f, kcal/mol:	46.86
Dipole, Da:	4.5
IP(EA), eV:	-9.13(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(2S,3S)-2-[[(2R)-4-methanehydrazonoylmorpholin-2-yl]methylcarbamoyl]-3-[(4-phenylphenyl)sulfonylamino]cyclopropyl]propanoylamino]acetic acid

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C=NNC(=O)C2=CC=CS2=O

DOS

IR

Vibrations