Geometry & MOs

Info

ID:	342881
PubChem CID:	127266044
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	331.169605
ΔH_f, kcal/mol:	-7.65
Dipole, Da:	5.35
IP(EA), eV:	-8.98(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[1-[2-(4-fluorophenyl)propan-2-yl]cyclopropyl]urea

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)NC(=O)NC2(CC2)C(C)(C)C3=CC=CC=C3

DOS

IR

Vibrations