Geometry & MOs

Info

ID:	45636
PubChem CID:	10515880
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	266.235814
ΔH_f, kcal/mol:	-196.67
Dipole, Da:	4.89
IP(EA), eV:	-11.21(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-1-methyl-1,5-diazacycloheptadec-3-en-2-one

Drug info:

PubChemData

Smile

CCCCC1(C2C(=O)NC(=O)C1C(=O)NC2=O)CC

DOS

IR

Vibrations