Geometry & MOs

Info

ID:	574
PubChem CID:	3018
Reduced:	NO3C9H11 (2)
Stoich.:	AB3C9D11 (2)
Weight, g/mol:	362.147786
ΔH_f, kcal/mol:	-188.85
Dipole, Da:	3.5
IP(EA), eV:	-9.63(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[2,5-dicyclopropyl-4-(ethoxycarbonylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)NC1=C(C(=O)C(=C(C1=O)C2CC2)NC(=O)OCC)C3CC3

DOS

IR

Vibrations