Geometry & MOs

Info

ID:	252169
PubChem CID:	103109567
Reduced:	ON3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-0.4
Dipole, Da:	1.05
IP(EA), eV:	-8.66(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(1,4-dioxan-2-ylmethyl)-1-N-ethyl-1-N-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(C)CC(C)NCC1=NOC(=C1)C

DOS

IR

Vibrations