Geometry & MOs

Info

ID:	357855
PubChem CID:	127294698
Reduced:	O2N5C20H35 (1)
Stoich.:	A2B5C20D35 (1)
Weight, g/mol:	370.167477
ΔH_f, kcal/mol:	-61.64
Dipole, Da:	5.0
IP(EA), eV:	-8.61(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxothiolan-3-yl)-1-methyl-3-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]urea

Drug info:

PubChemData

Smile

CC1CCC(N1CCN2CCN(CC2)C(=O)NCCC3=C(ON=C3C)C)C

DOS

IR

Vibrations