Geometry & MOs

Info

ID:	24286
PubChem CID:	609086
Reduced:	C3H5 (6)
Stoich.:	A3B5 (6)
Weight, g/mol:	246.234751
ΔH_f, kcal/mol:	-53.31
Dipole, Da:	0.12
IP(EA), eV:	-9.43(1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-prop-1-enyl-5-propyladamantane

Drug info:

PubChemData

Smile

CCCC12CC3CC(C1)(CC(C3)(C2)C=CC)CC

DOS

IR

Vibrations