Geometry & MOs

Info

ID:	70684
PubChem CID:	48413717
Reduced:	N2O4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	418.08921
ΔH_f, kcal/mol:	-129.31
Dipole, Da:	1.94
IP(EA), eV:	-8.69(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC(C)C(=O)NC(CN2CCOCC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations