Geometry & MOs

Info

ID:	52618
PubChem CID:	12015557
Reduced:	O3C18H28 (1)
Stoich.:	A3B18C28 (1)
Weight, g/mol:	264.172545
ΔH_f, kcal/mol:	-120.36
Dipole, Da:	2.62
IP(EA), eV:	-9.61(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-4-[(R)-methoxy-[(1R,2R,3S,4S)-3-methyl-2-bicyclo[2.2.1]hept-5-enyl]methoxy]hexa-1,5-dien-3-ol

Drug info:

PubChemData

Smile

C[C@H]1[C@H]2C[C@@H]([C@@H]1[C@H](OC)O[C@@H]3CC/C=C\CC[C@@H]3O)C=C2

DOS

IR

Vibrations