Geometry & MOs

Info

ID:	181325
PubChem CID:	76730980
Reduced:	NO4C29H31 (1)
Stoich.:	AB4C29D31 (1)
Weight, g/mol:	366.146724
ΔH_f, kcal/mol:	-124.58
Dipole, Da:	1.96
IP(EA), eV:	-8.95(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(furan-2-yl)-1,4-dihydroxy-3-methyl-3-[(4-phenylphenyl)methoxy]butan-2-one

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2=CC=C(C=C2)COC(C)C(=O)N3C(C(OC3=O)(C)C)C4=CC=CC=C4

DOS

IR

Vibrations