Geometry & MOs

Info

ID:	365393
PubChem CID:	127317792
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	377.177313
ΔH_f, kcal/mol:	-124.79
Dipole, Da:	2.41
IP(EA), eV:	-8.54(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2=CN=C(C=C2)OC3CCCC3

DOS

IR

Vibrations