Geometry & MOs

Info

ID:	358253
PubChem CID:	127295798
Reduced:	O3N4C19H32 (1)
Stoich.:	A3B4C19D32 (1)
Weight, g/mol:	283.189592
ΔH_f, kcal/mol:	-151.72
Dipole, Da:	4.84
IP(EA), eV:	-9.58(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C1)CC(=O)N2CCCN(CC2)C(=O)NC3CCCCNC3=O

DOS

IR

Vibrations