Geometry & MOs

Info

ID:	370588
PubChem CID:	127339726
Reduced:	ON5C18H27 (1)
Stoich.:	AB5C18D27 (1)
Weight, g/mol:	380.16306
ΔH_f, kcal/mol:	4.96
Dipole, Da:	6.41
IP(EA), eV:	-9.01(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dimethyl-N-[2-[4-(1-methylpyrazol-4-yl)piperidin-1-yl]-2-oxoethyl]imidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C(C)C(=O)N2CCC(CC2)C3=CN(N=C3)C

DOS

IR

Vibrations