Geometry & MOs

Info

ID:	370391
PubChem CID:	127338434
Reduced:	SN3O3C18H25 (1)
Stoich.:	AB3C3D18E25 (1)
Weight, g/mol:	263.188529
ΔH_f, kcal/mol:	-101.61
Dipole, Da:	2.54
IP(EA), eV:	-8.86(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(oxolan-3-yl)adamantane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC1)SC2=C(C=CC=N2)C(=O)N(C)C3CCOC3

DOS

IR

Vibrations