Geometry & MOs

Info

ID:	266832
PubChem CID:	103579709
Reduced:	BrNOC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	326.06299
ΔH_f, kcal/mol:	-44.62
Dipole, Da:	1.21
IP(EA), eV:	-8.43(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-3,5-dimethylanilino)-1-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC2CCOC2

DOS

IR

Vibrations