Geometry & MOs

Info

ID:	84948
PubChem CID:	49870881
Reduced:	O3N4H20C23 (1)
Stoich.:	A3B4C20D23 (1)
Weight, g/mol:	388.133554
ΔH_f, kcal/mol:	-1.69
Dipole, Da:	2.4
IP(EA), eV:	-8.28(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-4-(furan-2-yl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(N2C3=CC=CC=C3N=C2N1)C4=CC=CO4)C(=O)NC5=CC=C(C=C5)OC

DOS

IR

Vibrations