Geometry & MOs

Info

ID:	162585
PubChem CID:	57395147
Reduced:	N6C19H30 (2)
Stoich.:	A6B19C30 (2)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	150.56
Dipole, Da:	4.82
IP(EA), eV:	-8.48(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-1-benzyl-2-(nitrosomethylidene)-1,3-diazinane

Drug info:

PubChemData

Smile

C1CNCCCN(CCCNC1)CC2=CN(N=N2)CC(CC3=CC=CC4=CC=CC=C43)CN5C=C(N=N5)CN6CCCNCCCNCCC6

DOS

IR

Vibrations