Geometry & MOs

Info

ID:	357287
PubChem CID:	127293920
Reduced:	O2N5C14H17 (1)
Stoich.:	A2B5C14D17 (1)
Weight, g/mol:	363.161663
ΔH_f, kcal/mol:	3.47
Dipole, Da:	8.66
IP(EA), eV:	-9.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[2-methyl-5-(thiomorpholine-4-carbonyl)phenyl]-1-(oxolan-3-yl)urea

Drug info:

PubChemData

Smile

CN(C1CCOC1)C(=O)NC2=CC=C(C=C2)N3C=CN=N3

DOS

IR

Vibrations