Geometry & MOs

Info

ID:	156495
PubChem CID:	56370857
Reduced:	SN3O3C23H35 (1)
Stoich.:	AB3C3D23E35 (1)
Weight, g/mol:	360.241293
ΔH_f, kcal/mol:	-128.14
Dipole, Da:	5.11
IP(EA), eV:	-8.79(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-2-(2,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)N2CCC(C2)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations