Geometry & MOs

Info

ID:	369927
PubChem CID:	127336773
Reduced:	SO2N3C19H29 (1)
Stoich.:	AB2C3D19E29 (1)
Weight, g/mol:	361.236542
ΔH_f, kcal/mol:	-66.37
Dipole, Da:	4.93
IP(EA), eV:	-8.51(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-2-(oxan-4-yl)ethyl]-3-[1-(1-phenylethyl)pyrrolidin-3-yl]urea

Drug info:

PubChemData

Smile

CC1C(S(=O)CCN1C(=O)NC2CCN(C2)C(C)C3=CC=CC=C3)C

DOS

IR

Vibrations