Geometry & MOs

Info

ID:	181004
PubChem CID:	76715106
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	705.2884
ΔH_f, kcal/mol:	-107.22
Dipole, Da:	3.23
IP(EA), eV:	-9.16(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

18-(1,3-benzoxazol-2-yloxy)-14-[(4-fluoro-3-methylphenyl)methyl]-N-(1-methylcyclopropyl)sulfonyl-2,15-dioxo-16-azatricyclo[14.3.0.04,6]nonadec-7-ene-4-carboxamide

Drug info:

PubChemData

Smile

C=C(C(CC1CCCCC1)CC(=O)N2CCNCC2)O

DOS

IR

Vibrations