Geometry & MOs

Info

ID:	329833
PubChem CID:	127246700
Reduced:	SO2N4C16H26 (1)
Stoich.:	AB2C4D16E26 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-66.57
Dipole, Da:	6.89
IP(EA), eV:	-8.46(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-methoxyphenyl)cyclopropyl]-[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC=CC(=C1)C2CCCN2C3CCN(CC3)S(=O)(=O)C

DOS

IR

Vibrations