Geometry & MOs

Info

ID:	256136
PubChem CID:	103137285
Reduced:	NC4H4 (4)
Stoich.:	AB4C4 (4)
Weight, g/mol:	200.17763
ΔH_f, kcal/mol:	88.99
Dipole, Da:	3.92
IP(EA), eV:	-8.52(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-(5-methyloxolan-2-yl)pentan-3-ol

Drug info:

PubChemData

Smile

CN(CC1=CC=NC=C1)C2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations