Geometry & MOs

Info

ID:	195707
PubChem CID:	78726228
Reduced:	SN2O4C13H14 (1)
Stoich.:	AB2C4D13E14 (1)
Weight, g/mol:	362.130028
ΔH_f, kcal/mol:	-111.01
Dipole, Da:	3.52
IP(EA), eV:	-9.44(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-2-oxoethyl] 3-thiophen-3-ylprop-2-enoate

Drug info:

PubChemData

Smile

C1CC1NC(=O)NC(=O)COC(=O)C=CC2=CSC=C2

DOS

IR

Vibrations