Geometry & MOs

Info

ID:	283980
PubChem CID:	104023318
Reduced:	ON3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	20.07
Dipole, Da:	1.63
IP(EA), eV:	-8.92(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations