Geometry & MOs

Info

ID:	197269
PubChem CID:	78945269
Reduced:	O2N3C11H19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	272.061949
ΔH_f, kcal/mol:	-60.99
Dipole, Da:	3.02
IP(EA), eV:	-9.51(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyanophenyl)methyl]-3-methoxythiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C(=O)OC)NC(C)CN1C=CC=N1

DOS

IR

Vibrations