Geometry & MOs

Info

ID:	131122
PubChem CID:	51159609
Reduced:	NO2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	371.119129
ΔH_f, kcal/mol:	-162.39
Dipole, Da:	4.85
IP(EA), eV:	-8.3(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)C(CC(C)C)N2C(=O)C3CC=CCC3C2=O

DOS

IR

Vibrations