Geometry & MOs

Info

ID:	449060
PubChem CID:	135295637
Reduced:	SN2O2C24H30 (1)
Stoich.:	AB2C2D24E30 (1)
Weight, g/mol:	432.176168
ΔH_f, kcal/mol:	-21.44
Dipole, Da:	6.44
IP(EA), eV:	-7.92(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,6-difluorocarbazol-9-yl)-3-[N-methyl-4-(1H-pyrazol-5-yl)anilino]propan-2-ol

Drug info:

PubChemData

Smile

CS(=O)N(CC1CC2CCC1C2)CC(CN3C4=CC=CC=C4C5=CC=CC=C53)O

DOS

IR

Vibrations