Geometry & MOs

Info

ID:	354463
PubChem CID:	127286907
Reduced:	N3O3C17H31 (1)
Stoich.:	A3B3C17D31 (1)
Weight, g/mol:	299.220892
ΔH_f, kcal/mol:	-159.61
Dipole, Da:	2.66
IP(EA), eV:	-9.07(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-morpholin-4-ylbutan-2-yl)-3-(oxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CCOC(C1)CNC(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations