Geometry & MOs

Info

ID:	268105
PubChem CID:	103597893
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	348.241293
ΔH_f, kcal/mol:	-69.25
Dipole, Da:	4.09
IP(EA), eV:	-8.8(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)-N-[2-(2-methoxyethoxy)ethyl]prop-2-enamide

Drug info:

PubChemData

Smile

CCC=C(C)C(=O)NCC1=CC=C(C=C1)CN2CCOCC2

DOS

IR

Vibrations