Geometry & MOs

Info

ID:	29521
PubChem CID:	834701
Reduced:	BrNO2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	286.148141
ΔH_f, kcal/mol:	-68.74
Dipole, Da:	2.21
IP(EA), eV:	-8.95(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-fluorophenyl)methyl]-4-morpholin-4-ylaniline

Drug info:

PubChemData

Smile

CC[C@H](CO)NCC1=CC(=C(C=C1)OC)Br

DOS

IR

Vibrations