Geometry & MOs

Info

ID:	290873
PubChem CID:	111386651
Reduced:	ISO2N5C20H36 (1)
Stoich.:	ABC2D5E20F36 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-64.28
Dipole, Da:	2.19
IP(EA), eV:	-8.39(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[6-(cyclopropylmethoxy)pyridin-3-yl]methyl]-3-[2-(2-methoxy-5-methylphenyl)ethyl]-2-methylguanidine

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCCNC(=NC)NCCS(=O)(=O)NCC2=CC=CC=C2.I

DOS

IR

Vibrations