Geometry & MOs

Info

ID:	354006
PubChem CID:	127285663
Reduced:	N3O4C19H29 (1)
Stoich.:	A3B4C19D29 (1)
Weight, g/mol:	273.168856
ΔH_f, kcal/mol:	-161.16
Dipole, Da:	4.03
IP(EA), eV:	-9.1(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dioxan-2-ylmethyl)-3-[(4-methylmorpholin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CN(CCC1O)CC2=CC=C(C=C2)CNC(=O)NCC3COCCO3

DOS

IR

Vibrations