Geometry & MOs

Info

ID:	280838
PubChem CID:	103851554
Reduced:	NC5H9 (3)
Stoich.:	AB5C9 (3)
Weight, g/mol:	291.143471
ΔH_f, kcal/mol:	-6.14
Dipole, Da:	2.43
IP(EA), eV:	-8.8(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-[(3,5-difluorophenyl)methylamino]butyl]phenol

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CNC2CCCC(C2)C(C)C

DOS

IR

Vibrations