Geometry & MOs

Info

ID:	347697
PubChem CID:	127272577
Reduced:	ClSN2O4C18H23 (1)
Stoich.:	ABC2D4E18F23 (1)
Weight, g/mol:	389.150619
ΔH_f, kcal/mol:	-178.4
Dipole, Da:	4.59
IP(EA), eV:	-9.47(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-chlorophenyl)-2-morpholin-4-ylethyl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)NC(=O)CC3CCS(=O)(=O)C3

DOS

IR

Vibrations