Geometry & MOs

Info

ID:	325711
PubChem CID:	126684597
Reduced:	FNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	335.136887
ΔH_f, kcal/mol:	-92.13
Dipole, Da:	5.68
IP(EA), eV:	-9.32(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[(E)-5-[(5E)-5-(1-hydroxy-2-methylprop-2-enylidene)-4,6-dioxopyran-2-yl]hex-1-enyl]carbamate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC(=C1)CNCC2CCOC2)F

DOS

IR

Vibrations