Geometry & MOs

Info

ID:	58860
PubChem CID:	24714989
Reduced:	NO4C20H27 (1)
Stoich.:	AB4C20D27 (1)
Weight, g/mol:	303.163457
ΔH_f, kcal/mol:	-101.7
Dipole, Da:	4.82
IP(EA), eV:	-8.42(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[[cyclopropyl-[(3-fluorophenyl)methyl]amino]methyl]furan-2-yl]propan-2-ol

Drug info:

PubChemData

Smile

CC(C)(C1=CC=C(O1)CN(CC2=C(C(=CC=C2)OC)OC)C3CC3)O

DOS

IR

Vibrations