Geometry & MOs

Info

ID:	397638
PubChem CID:	135030500
Reduced:	BO4C22H33 (1)
Stoich.:	AB4C22D33 (1)
Weight, g/mol:	374.26284
ΔH_f, kcal/mol:	-204.93
Dipole, Da:	4.01
IP(EA), eV:	-8.79(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)/C=C/C=C(\C)/C#C[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C

DOS

IR

Vibrations