Geometry & MOs

Info

ID:	196639
PubChem CID:	78857100
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	363.080826
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	6.42
IP(EA), eV:	-9.19(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-chlorophenyl)methyl]-N-(1-hydroxypropan-2-yl)-3-methylthieno[2,3-c]pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)NC(C)CO

DOS

IR

Vibrations