Geometry & MOs

Info

ID:	249670
PubChem CID:	103091230
Reduced:	OC12H22 (1)
Stoich.:	AB12C22 (1)
Weight, g/mol:	207.162314
ΔH_f, kcal/mol:	-80.33
Dipole, Da:	2.27
IP(EA), eV:	-9.48(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(1-ethyl-2,5-dimethylpyrrol-3-yl)-3-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

CC1CCC(CC1)C=C(C)C(C)O

DOS

IR

Vibrations