Geometry & MOs

Info

ID:	298909
PubChem CID:	117664297
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	358.214409
ΔH_f, kcal/mol:	-23.26
Dipole, Da:	4.9
IP(EA), eV:	-8.32(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[(E)-2-cyclohexylethenyl]-2-hydroxy-4-methoxy-3-(3-methylbut-3-enyl)benzoate

Drug info:

PubChemData

Smile

CC(=C)CCNC(=O)NC1=C(C=C(C=C1)/C=C/C2=CC=CC=C2)OC

DOS

IR

Vibrations