Geometry & MOs

Info

ID:	64715
PubChem CID:	29203898
Reduced:	FO2N4C18H19 (1)
Stoich.:	AB2C4D18E19 (1)
Weight, g/mol:	356.164854
ΔH_f, kcal/mol:	-74.27
Dipole, Da:	5.03
IP(EA), eV:	-9.01(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]methylurea

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC(=CC=C3)NC(=O)N

DOS

IR

Vibrations