Geometry & MOs

Info

ID:	160077
PubChem CID:	57304628
Reduced:	ON2C23H30 (1)
Stoich.:	AB2C23D30 (1)
Weight, g/mol:	86.066972
ΔH_f, kcal/mol:	-15.26
Dipole, Da:	1.29
IP(EA), eV:	-8.72(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5,6-tetradeuterio-2H-pyran

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)CCCCO)CC2=CC=CC3=C2C=C(C=C3)CC(C)C

DOS

IR

Vibrations