Geometry & MOs

Info

ID:	128744
PubChem CID:	51056744
Reduced:	SN2O2C15H16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	251.08071
ΔH_f, kcal/mol:	-49.74
Dipole, Da:	3.18
IP(EA), eV:	-8.59(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NCN2C3=CC=CC=C3SC2=O.O

DOS

IR

Vibrations