Geometry & MOs

Info

ID:	441657
PubChem CID:	135238947
Reduced:	N3O4C16H25 (1)
Stoich.:	A3B4C16D25 (1)
Weight, g/mol:	381.109149
ΔH_f, kcal/mol:	-171.51
Dipole, Da:	2.35
IP(EA), eV:	-8.77(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(1S)-2-(4-chlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1,2,4-oxadiazol-5-yl]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC)CC(=O)NN

DOS

IR

Vibrations