Geometry & MOs

Info

ID:	290639
PubChem CID:	109796661
Reduced:	IN7C26H32 (1)
Stoich.:	AB7C26D32 (1)
Weight, g/mol:	343.237211
ΔH_f, kcal/mol:	123.2
Dipole, Da:	3.41
IP(EA), eV:	-8.96(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-methyl-3-(pyridin-2-ylmethyl)guanidine

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=CC=CC=C2CNC(=NC)NCC3=C(N(N=C3C)C4=CC=CC=C4)C)C.I

DOS

IR

Vibrations