Geometry & MOs

Info

ID:	283977
PubChem CID:	104023306
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	286.148141
ΔH_f, kcal/mol:	-26.41
Dipole, Da:	5.06
IP(EA), eV:	-7.78(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3,4-dihydro-2H-1,5-benzoxazepin-5-ylmethyl)-5-fluorophenyl]methanamine

Drug info:

PubChemData

Smile

C1CCC(C(CC1)N2CCCOC3=CC=CC=C32)CN

DOS

IR

Vibrations