Geometry & MOs

Info

ID:	256054
PubChem CID:	103136654
Reduced:	N3C18H19 (1)
Stoich.:	A3B18C19 (1)
Weight, g/mol:	281.179107
ΔH_f, kcal/mol:	71.92
Dipole, Da:	2.59
IP(EA), eV:	-9.1(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-2-[(5-methyloxolan-2-yl)methoxy]phenyl]butan-2-amine

Drug info:

PubChemData

Smile

CCNC(C1=CC=CC2=C1C=NC=C2)C3=CN=CC(=C3)C

DOS

IR

Vibrations