Geometry & MOs

Info

ID:	311160
PubChem CID:	126589658
Reduced:	OC14H26 (1)
Stoich.:	AB14C26 (1)
Weight, g/mol:	412.179835
ΔH_f, kcal/mol:	-94.18
Dipole, Da:	2.88
IP(EA), eV:	-9.3(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-[(E)-but-2-en-2-yl]-13-[(E)-2-fluoroethenyl]-7-hydroxy-15-propyl-5-oxa-1,12-diazatetracyclo[8.7.0.03,8.011,16]heptadeca-3(8),9,11(16),14-tetraene-2,6-dione

Drug info:

PubChemData

Smile

CCC(C)(CC)C(=O)C1CCC(CC1)C

DOS

IR

Vibrations