Geometry & MOs

Info

ID:	254783
PubChem CID:	103127644
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	302.093439
ΔH_f, kcal/mol:	56.02
Dipole, Da:	2.92
IP(EA), eV:	-8.54(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chloro-3-methoxyphenyl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylmethanamine

Drug info:

PubChemData

Smile

CCC(=C)CC(C1=C2C=CC=CN2N=C1)NCC

DOS

IR

Vibrations