Geometry & MOs

Info

ID:	41552
PubChem CID:	8146254
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	407.161184
ΔH_f, kcal/mol:	61.02
Dipole, Da:	7.37
IP(EA), eV:	-8.91(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3S)-1-[[(4S)-4-(3-chlorophenyl)-4-ethyl-2,5-dioxoimidazolidin-1-yl]methyl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N=C/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C

DOS

IR

Vibrations