Geometry & MOs

Info

ID:	290869
PubChem CID:	111370075
Reduced:	N2C7H13 (2)
Stoich.:	A2B7C13 (2)
Weight, g/mol:	408.35766
ΔH_f, kcal/mol:	39.42
Dipole, Da:	4.52
IP(EA), eV:	-8.72(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[[N-ethyl-N'-[3-(2-methylpiperidin-1-yl)propyl]carbamimidoyl]amino]butyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCN1CCCNC(=NC)NCC#C

DOS

IR

Vibrations