Geometry & MOs

Info

ID:	237257
PubChem CID:	92718041
Reduced:	ClNO2H10C12 (2)
Stoich.:	ABC2D10E12 (2)
Weight, g/mol:	384.06847
ΔH_f, kcal/mol:	-110.52
Dipole, Da:	4.34
IP(EA), eV:	-9.65(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 2-[(3-bromobenzoyl)amino]acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C2=CC=C(C=C2)Cl)NC(=O)COC(=O)CNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations