Geometry & MOs

Info

ID:	279972
PubChem CID:	103845996
Reduced:	ClINC9H11 (1)
Stoich.:	ABCD9E11 (1)
Weight, g/mol:	255.02588
ΔH_f, kcal/mol:	26.54
Dipole, Da:	4.24
IP(EA), eV:	-9.3(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-5,7-dimethyl-3,4-dihydro-2H-chromen-4-amine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)I)Cl)NC

DOS

IR

Vibrations