Geometry & MOs

Info

ID:	352046
PubChem CID:	127283114
Reduced:	ClN3O3C20H30 (1)
Stoich.:	AB3C3D20E30 (1)
Weight, g/mol:	329.231456
ΔH_f, kcal/mol:	-128.35
Dipole, Da:	2.77
IP(EA), eV:	-8.72(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-hydroxyoxan-4-yl)methyl]-3-[[4-(2-methylpropyl)morpholin-2-yl]methyl]urea

Drug info:

PubChemData

Smile

CC(C)CN1CCOC(C1)CNC(=O)N2CCOC(C2)C3=CC=CC=C3Cl

DOS

IR

Vibrations