Geometry & MOs

Info

ID:	208370
PubChem CID:	80526154
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	251.109233
ΔH_f, kcal/mol:	38.46
Dipole, Da:	1.81
IP(EA), eV:	-8.39(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NC=C1)NCC(C)(C)C2=CC=CS2)N

DOS

IR

Vibrations