Geometry & MOs

Info

ID:	204717
PubChem CID:	79999819
Reduced:	NSO4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	307.124215
ΔH_f, kcal/mol:	-150.34
Dipole, Da:	4.69
IP(EA), eV:	-9.64(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[3-methyl-5-[(1-methylcyclopentyl)methylcarbamoyl]thiophen-2-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)C(=O)NCC2CCOCC2)/C=C/C(=O)O

DOS

IR

Vibrations