Geometry & MOs

Info

ID:	26981
PubChem CID:	808815
Reduced:	N3H21C22 (1)
Stoich.:	A3B21C22 (1)
Weight, g/mol:	274.077599
ΔH_f, kcal/mol:	89.93
Dipole, Da:	2.39
IP(EA), eV:	-8.43(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-phenylpropanoyl)thiophene-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=C(N3C=CC=C(C3=N2)C)NCC4=CC=CC=C4

DOS

IR

Vibrations