Geometry & MOs

Info

ID:	126038
PubChem CID:	50949214
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	277.157898
ΔH_f, kcal/mol:	-46.75
Dipole, Da:	6.49
IP(EA), eV:	-8.85(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(pyrrolidin-1-ylmethyl)phenyl]indazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N=C(N2)CCNC(=O)C(C)(C)NC(=O)C3=CC=CS3

DOS

IR

Vibrations