Geometry & MOs

Info

ID:	77446
PubChem CID:	49635594
Reduced:	SN3O3C20H27 (1)
Stoich.:	AB3C3D20E27 (1)
Weight, g/mol:	382.180504
ΔH_f, kcal/mol:	-100.45
Dipole, Da:	5.16
IP(EA), eV:	-9.14(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-fluorophenoxy)-1-phenylethyl]-3-[2-(2-methylimidazol-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=CC=C(C=C1)CNC(=O)N(CCO)CC2=CSC=C2

DOS

IR

Vibrations