Geometry & MOs

Info

ID:	268815
PubChem CID:	103601066
Reduced:	BrN4C10H13 (1)
Stoich.:	AB4C10D13 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	59.0
Dipole, Da:	2.2
IP(EA), eV:	-8.9(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-butan-2-ylphenoxy)-N-(2-cyanoethyl)-N-methylacetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations