Geometry & MOs

Info

ID:	317317
PubChem CID:	126635591
Reduced:	NC11H13 (1)
Stoich.:	AB11C13 (1)
Weight, g/mol:	136.100048
ΔH_f, kcal/mol:	136.77
Dipole, Da:	2.0
IP(EA), eV:	-8.42(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5,5-trimethyldiazepine

Drug info:

PubChemData

Smile

C=CNCCC1=CC=CC#CC1

DOS

IR

Vibrations