Geometry & MOs

Info

ID:	291328
PubChem CID:	111978647
Reduced:	IO3N4C25H35 (1)
Stoich.:	AB3C4D25E35 (1)
Weight, g/mol:	438.263091
ΔH_f, kcal/mol:	-72.93
Dipole, Da:	5.92
IP(EA), eV:	-8.8(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-3-[(2,4-dimethoxyphenyl)methyl]-2-methylguanidine

Drug info:

PubChemData

Smile

CN=C(NCC1=C(C=C(C=C1)OC)OC)NCC(=O)N2CCC(CC2)CC3=CC=CC=C3.I

DOS

IR

Vibrations