Geometry & MOs

Info

ID:	74703
PubChem CID:	48422320
Reduced:	N3O5C17H19 (1)
Stoich.:	A3B5C17D19 (1)
Weight, g/mol:	415.156577
ΔH_f, kcal/mol:	-148.78
Dipole, Da:	2.07
IP(EA), eV:	-9.48(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-[2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)hydrazinyl]propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=O)NNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations