Geometry & MOs

Info

ID:	427889
PubChem CID:	135164975
Reduced:	OC14H28 (1)
Stoich.:	AB14C28 (1)
Weight, g/mol:	150.104465
ΔH_f, kcal/mol:	-105.27
Dipole, Da:	2.81
IP(EA), eV:	-9.58(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-3,4,4a,8a-tetrahydro-2H-chromene

Drug info:

PubChemData

Smile

CC(C)CCC(CC(=O)C(C)C)C(C)C

DOS

IR

Vibrations