Geometry & MOs

Info

ID:	374390
PubChem CID:	131328102
Reduced:	BrOF2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	143.105862
ΔH_f, kcal/mol:	-128.86
Dipole, Da:	2.38
IP(EA), eV:	-9.86(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-5-ethyl-1,3-diazinan-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C(=O)C)Br)C(F)F

DOS

IR

Vibrations