Geometry & MOs

Info

ID:	368910
PubChem CID:	127330918
Reduced:	O2N6C21H30 (1)
Stoich.:	A2B6C21D30 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-36.64
Dipole, Da:	2.26
IP(EA), eV:	-8.7(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,1-dioxothiolan-3-yl)methyl]-3-[4-(1-morpholin-4-ylethyl)phenyl]urea

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NC3=CC=C(C=C3)C(C)N4CCOCC4

DOS

IR

Vibrations