Geometry & MOs

Info

ID:	291931
PubChem CID:	113861008
Reduced:	OC17H24 (1)
Stoich.:	AB17C24 (1)
Weight, g/mol:	257.235479
ΔH_f, kcal/mol:	-45.24
Dipole, Da:	1.37
IP(EA), eV:	-9.09(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylheptyl)-2,2-dimethyl-1,3-dioxan-5-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CC(/C/2=C/CCCCCC2)O

DOS

IR

Vibrations