Geometry & MOs

Info

ID:	282148
PubChem CID:	103917134
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	340.07864
ΔH_f, kcal/mol:	-61.56
Dipole, Da:	2.68
IP(EA), eV:	-8.98(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amino]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

CCCCCC(C1=CC=CC=C1)NCC(C)(C)C(=O)N

DOS

IR

Vibrations