Geometry & MOs

Info

ID:	356037
PubChem CID:	127291066
Reduced:	N2O2C15H26 (1)
Stoich.:	A2B2C15D26 (1)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-122.24
Dipole, Da:	2.42
IP(EA), eV:	-9.3(1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(oxan-3-yl)-1-(oxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CCC(C1)C2CCCN2C(=O)NC3CCCOC3

DOS

IR

Vibrations