Geometry & MOs

Info

ID:	364890
PubChem CID:	127316478
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	370.167477
ΔH_f, kcal/mol:	-64.95
Dipole, Da:	4.22
IP(EA), eV:	-8.75(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-(4-cyclobutylpiperazin-1-yl)-1-oxopropan-2-yl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)NC(=O)CC4

DOS

IR

Vibrations