Geometry & MOs

Info

ID:	229469
PubChem CID:	87567764
Reduced:	ClN2O7H29C32 (1)
Stoich.:	AB2C7D29E32 (1)
Weight, g/mol:	284.01604
ΔH_f, kcal/mol:	-123.7
Dipole, Da:	2.53
IP(EA), eV:	-8.5(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[acetamido(phenyl)methyl]-2-bromoacetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OCCNC(CC(=O)OOC2=CC=CC3=C2C4=CC=CC=C4N3)C5=C(C=CC(=C5)CCl)C(=O)O

DOS

IR

Vibrations