Geometry & MOs

Info

ID:	34764
PubChem CID:	7978912
Reduced:	NSO5C22H23 (1)
Stoich.:	ABC5D22E23 (1)
Weight, g/mol:	363.194677
ΔH_f, kcal/mol:	-153.98
Dipole, Da:	5.4
IP(EA), eV:	-8.17(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(1-adamantyl)acetyl]quinoline-2-carbohydrazide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OCCOC(=O)[C@@H]2CS[C@]3(N2C(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations