Geometry & MOs

Info

ID:	410183
PubChem CID:	135082974
Reduced:	O5C20H24 (1)
Stoich.:	A5B20C24 (1)
Weight, g/mol:	1634.356339
ΔH_f, kcal/mol:	-190.61
Dipole, Da:	2.57
IP(EA), eV:	-9.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C[C@@H](CC1=O)O/C=C/2\[C@H]3CC4=C([C@H]3OC2=O)C(CC[C@@H]4O)(C)C

DOS

IR

Vibrations