Geometry & MOs

Info

ID:	152321
PubChem CID:	56311228
Reduced:	OSN5C21H23 (1)
Stoich.:	ABC5D21E23 (1)
Weight, g/mol:	322.204513
ΔH_f, kcal/mol:	90.9
Dipole, Da:	6.36
IP(EA), eV:	-9.04(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopropylmethyl(1-phenylethyl)amino]-N-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N(CC2CC2)CC3=NN=C4N3C5=C(C(=O)N4C)SC=C5

DOS

IR

Vibrations