Geometry & MOs

Info

ID:	289597
PubChem CID:	104359918
Reduced:	NOBr2H15C16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	307.053069
ΔH_f, kcal/mol:	12.13
Dipole, Da:	5.16
IP(EA), eV:	-8.91(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(5-chloro-2,3-dihydro-1-benzofuran-7-yl)methyl]-4-methylaniline

Drug info:

PubChemData

Smile

C1COC2=C1C=C(C=C2CNCC3=CC=C(C=C3)Br)Br

DOS

IR

Vibrations