Geometry & MOs

Info

ID:	441459
PubChem CID:	135234943
Reduced:	O2S2N4H12C15 (1)
Stoich.:	A2B2C4D12E15 (1)
Weight, g/mol:	173.152812
ΔH_f, kcal/mol:	8.92
Dipole, Da:	6.04
IP(EA), eV:	-8.52(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-2-methyl-3-pentylguanidine

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)N=C(N2)SC3=C(C=C4C(=C3)NC(=S)N4)O

DOS

IR

Vibrations