Geometry & MOs

Info

ID:	234093
PubChem CID:	92297705
Reduced:	BrN2O3C10H11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	255.219829
ΔH_f, kcal/mol:	-39.75
Dipole, Da:	6.29
IP(EA), eV:	-10.14(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-methoxypropan-2-yl]undec-10-enamide

Drug info:

PubChemData

Smile

C[C@H](CNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])Br

DOS

IR

Vibrations