Geometry & MOs

Info

ID:	411347
PubChem CID:	135084170
Reduced:	BrF3H8C11 (1)
Stoich.:	AB3C8D11 (1)
Weight, g/mol:	301.03136
ΔH_f, kcal/mol:	-110.53
Dipole, Da:	4.56
IP(EA), eV:	-9.92(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-(2-bromophenyl)-N-(1-methoxypropan-2-yl)carbamate

Drug info:

PubChemData

Smile

C=C/C(=C/C1=CC=C(C=C1)C(F)(F)F)/Br

DOS

IR

Vibrations