Geometry & MOs

Info

ID:	190959
PubChem CID:	78086719
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	348.161997
ΔH_f, kcal/mol:	-15.78
Dipole, Da:	6.45
IP(EA), eV:	-8.89(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1-(1-methylimidazol-4-yl)sulfonyl-4-(4-methylphenyl)pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C2CN(CC2NC(=O)C)CC3=CC(=CC=C3)C#N

DOS

IR

Vibrations