Geometry & MOs

Info

ID:	192560
PubChem CID:	78286405
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	376.15537
ΔH_f, kcal/mol:	-172.71
Dipole, Da:	8.26
IP(EA), eV:	-9.39(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-cyano-3-methylbutan-2-yl)amino]-2-oxoethyl] 1-(4-chlorophenyl)cyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(C)(C#N)NC(=O)COC(=O)C1=CC(=CC(=C1)OC)OC

DOS

IR

Vibrations