Geometry & MOs

Info

ID:	137328
PubChem CID:	52191483
Reduced:	OF2N3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-99.83
Dipole, Da:	4.98
IP(EA), eV:	-8.69(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-pyrrolidin-1-ylphenyl)urea

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)F)F)NC(=O)NC2=CC=CC=C2N3CCCC3

DOS

IR

Vibrations