Geometry & MOs

Info

ID:	355864
PubChem CID:	127290716
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	368.150285
ΔH_f, kcal/mol:	-69.19
Dipole, Da:	3.19
IP(EA), eV:	-9.35(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COCCC1NC(=O)N2CC3=CC=CC=C3C2

DOS

IR

Vibrations