Geometry & MOs

Info

ID:	269385
PubChem CID:	103617247
Reduced:	OBr2N2C15H20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-20.19
Dipole, Da:	2.32
IP(EA), eV:	-8.44(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-[(4-nitrophenyl)methylamino]propanamide

Drug info:

PubChemData

Smile

C1CC2CC(CCN2C1)NCC3=CC(=C(C(=C3)Br)O)Br

DOS

IR

Vibrations