Geometry & MOs

Info

ID:	122732
PubChem CID:	50819438
Reduced:	O2N4H20C25 (1)
Stoich.:	A2B4C20D25 (1)
Weight, g/mol:	384.196154
ΔH_f, kcal/mol:	78.63
Dipole, Da:	4.66
IP(EA), eV:	-9.29(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[N-(4-fluorophenyl)-N'-(2-morpholin-4-ylethyl)carbamimidoyl]-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC4=NC(=NO4)C5=CC=CC(=C5)C

DOS

IR

Vibrations