Geometry & MOs

Info

ID:	349461
PubChem CID:	127275248
Reduced:	ClO2N3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	380.121545
ΔH_f, kcal/mol:	-63.78
Dipole, Da:	1.9
IP(EA), eV:	-9.02(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CN=C(O1)CN2CCC(CC2)C3C4=C(C=C(C=C4)Cl)NC3=O

DOS

IR

Vibrations