Geometry & MOs

Info

ID:	171621
PubChem CID:	75407468
Reduced:	FN2O3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	338.166414
ΔH_f, kcal/mol:	-165.88
Dipole, Da:	2.22
IP(EA), eV:	-9.78(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(ethylcarbamoylamino)cyclohexyl] 2-methyl-2-thiophen-2-ylpropanoate

Drug info:

PubChemData

Smile

CCNC(=O)NC1CCC(CC1)OC(=O)C2(CC2)C3=CC(=CC=C3)F

DOS

IR

Vibrations