Geometry & MOs

Info

ID:	349463
PubChem CID:	127275250
Reduced:	ClO3N4C18H21 (1)
Stoich.:	AB3C4D18E21 (1)
Weight, g/mol:	372.146537
ΔH_f, kcal/mol:	-110.48
Dipole, Da:	3.14
IP(EA), eV:	-8.92(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-4-yl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

C1CN(CCC1C2C3=C(C=C(C=C3)Cl)NC2=O)CCN4C(=O)CNC4=O

DOS

IR

Vibrations