Geometry & MOs

Info

ID:	50100
PubChem CID:	12012603
Reduced:	NO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	-62.89
Dipole, Da:	4.24
IP(EA), eV:	-9.41(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-hex-1-enyl]-1-hydroxy-2,2,5,5-tetramethylpyrrole-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1=C(C(N(C1(C)C)O)(C)C)C=O

DOS

IR

Vibrations