Geometry & MOs

Info

ID:	34617
PubChem CID:	7978737
Reduced:	ClN4O4C20H25 (1)
Stoich.:	AB4C4D20E25 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-141.53
Dipole, Da:	6.45
IP(EA), eV:	-9.84(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]adamantane-1-carbohydrazide

Drug info:

PubChemData

Smile

CCCCN1C(=C(C(=N1)C)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)NC(=O)NCC)Cl

DOS

IR

Vibrations