Geometry & MOs

Info

ID:	58535
PubChem CID:	24702263
Reduced:	NO2C6H7 (2)
Stoich.:	AB2C6D7 (2)
Weight, g/mol:	205.157898
ΔH_f, kcal/mol:	-141.55
Dipole, Da:	4.88
IP(EA), eV:	-9.39(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[benzyl(methyl)amino]butanimidamide

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=CC=C1OCC(=O)NC(=O)N

DOS

IR

Vibrations