Geometry & MOs

Info

ID:	9078
PubChem CID:	85841
Reduced:	BrON2C5H7 (1)
Stoich.:	ABC2D5E7 (1)
Weight, g/mol:	189.97418
ΔH_f, kcal/mol:	-6.11
Dipole, Da:	4.78
IP(EA), eV:	-10.01(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-2-cyano-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C(C#N)Br

DOS

IR

Vibrations