Geometry & MOs

Info

ID:	358401
PubChem CID:	127295946
Reduced:	N3O4C19H27 (1)
Stoich.:	A3B4C19D27 (1)
Weight, g/mol:	347.220892
ΔH_f, kcal/mol:	-153.76
Dipole, Da:	4.28
IP(EA), eV:	-8.66(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(2-methyl-4-morpholin-4-ylphenyl)-1-(oxan-3-ylmethyl)urea

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)NC2=CC(=C(C=C2)OC)N3CCCC3=O

DOS

IR

Vibrations