Geometry & MOs

Info

ID:	171773
PubChem CID:	75425117
Reduced:	OSN2C18H18 (1)
Stoich.:	ABC2D18E18 (1)
Weight, g/mol:	336.02219
ΔH_f, kcal/mol:	16.23
Dipole, Da:	3.88
IP(EA), eV:	-9.03(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(5-bromo-2-methoxyphenyl)methoxy]pyrazine-2-carboximidamide

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C=C1)CC2=CSC(=N2)CCC3=CC=CC=C3

DOS

IR

Vibrations