Geometry & MOs

Info

ID:	441329
PubChem CID:	135234136
Reduced:	O2S2N7C29H29 (1)
Stoich.:	A2B2C7D29E29 (1)
Weight, g/mol:	159.100777
ΔH_f, kcal/mol:	64.6
Dipole, Da:	11.71
IP(EA), eV:	-9.21(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-aminoacetyl)butanehydrazide

Drug info:

PubChemData

Smile

C1CCC(CC(C1)CSC(=NC(=O)CC2=CC(=CC=C2)C#N)N)C3=NN=C(S3)NC(=O)CC4=CC(=CC=C4)C#N

DOS

IR

Vibrations