Geometry & MOs

Info

ID:	283978
PubChem CID:	104023314
Reduced:	FON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	220.157563
ΔH_f, kcal/mol:	-40.31
Dipole, Da:	2.32
IP(EA), eV:	-8.93(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)butan-1-amine

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C2OC1)CC3=CC(=CC(=C3)CN)F

DOS

IR

Vibrations