Geometry & MOs

Info

ID:	400337
PubChem CID:	135047620
Reduced:	VC21H33 (1)
Stoich.:	AB21C33 (1)
Weight, g/mol:	308.104442
ΔH_f, kcal/mol:	-25.74
Dipole, Da:	3.52
IP(EA), eV:	-8.41(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH3-].C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.[V]

DOS

IR

Vibrations