Geometry & MOs

Info

ID:	74900
PubChem CID:	48422667
Reduced:	FNSO2C16H22 (1)
Stoich.:	ABCD2E16F22 (1)
Weight, g/mol:	350.166414
ΔH_f, kcal/mol:	-108.97
Dipole, Da:	2.02
IP(EA), eV:	-8.9(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(cyclopropylmethoxy)propanoyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carbohydrazide

Drug info:

PubChemData

Smile

CC(C(=O)NCCCSC1=CC=C(C=C1)F)OCC2CC2

DOS

IR

Vibrations