Geometry & MOs

Info

ID:	47901
PubChem CID:	10535781
Reduced:	NO2C11H15 (1)
Stoich.:	AB2C11D15 (1)
Weight, g/mol:	193.110279
ΔH_f, kcal/mol:	-35.62
Dipole, Da:	4.44
IP(EA), eV:	-8.57(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,3R)-3-methyl-2-pyrrol-1-ylpent-4-enoate

Drug info:

PubChemData

Smile

CC1=NC=CC(=C1OC)OCC2CC2

DOS

IR

Vibrations