Geometry & MOs

Info

ID:	207945
PubChem CID:	80473143
Reduced:	BrClOC15H18 (1)
Stoich.:	ABCD15E18 (1)
Weight, g/mol:	127.074562
ΔH_f, kcal/mol:	-23.76
Dipole, Da:	4.14
IP(EA), eV:	-8.95(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-azidopentan-2-one

Drug info:

PubChemData

Smile

C1C2C1CC(C2)(CCOC3=CC=C(C=C3)Br)CCl

DOS

IR

Vibrations