Geometry & MOs

Info

ID:	50096
PubChem CID:	12012599
Reduced:	NOC14H19 (1)
Stoich.:	ABC14D19 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-2.16
Dipole, Da:	0.41
IP(EA), eV:	-9.24(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1-hydroxy-2,2,5,5-tetramethylpyrrol-3-yl)phenyl]methanol

Drug info:

PubChemData

Smile

CC1(C=C(C(N1O)(C)C)C2=CC=CC=C2)C

DOS

IR

Vibrations