Geometry & MOs

Info

ID:	203493
PubChem CID:	79837835
Reduced:	BrNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	311.08848
ΔH_f, kcal/mol:	-43.65
Dipole, Da:	4.1
IP(EA), eV:	-8.88(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-4-ethoxy-N-ethyl-3,3-dimethyl-1,2-dihydroinden-1-amine

Drug info:

PubChemData

Smile

CCOC1=C2C(=C(C=C1)Br)[C@H](CC2(C)C)N

DOS

IR

Vibrations