Geometry & MOs

Info

ID:	216085
PubChem CID:	85085687
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	223.96981
ΔH_f, kcal/mol:	-108.68
Dipole, Da:	3.07
IP(EA), eV:	-8.9(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(iodomethylidene)pent-4-en-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)C1C=CN(C=C1C=O)C(=O)OC

DOS

IR

Vibrations