Geometry & MOs

Info

ID:	434904
PubChem CID:	135175945
Reduced:	BrN2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	141.115364
ΔH_f, kcal/mol:	27.99
Dipole, Da:	2.31
IP(EA), eV:	-8.3(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-6-amino-6-methylhept-4-en-3-one

Drug info:

PubChemData

Smile

C/C=C/1\C(=C/C(C(=C)C)Br)\N(C(=N1)C)C(C)C

DOS

IR

Vibrations