Geometry & MOs

Info

ID:	131475
PubChem CID:	51211107
Reduced:	SN2O2C19H22 (1)
Stoich.:	AB2C2D19E22 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-56.85
Dipole, Da:	4.68
IP(EA), eV:	-8.94(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(adamantane-1-carbonyl)-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NCC(=O)NCCSC2=CC=C(C=C2)C

DOS

IR

Vibrations