Geometry & MOs

Info

ID:	156667
PubChem CID:	56371619
Reduced:	O2N5C22H31 (1)
Stoich.:	A2B5C22D31 (1)
Weight, g/mol:	445.203528
ΔH_f, kcal/mol:	-44.13
Dipole, Da:	3.89
IP(EA), eV:	-8.74(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-4-(furan-2-ylmethylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)N2CCC(C2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4

DOS

IR

Vibrations