Geometry & MOs

Info

ID:	196818
PubChem CID:	78882871
Reduced:	N5C17H19 (1)
Stoich.:	A5B17C19 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	101.99
Dipole, Da:	9.71
IP(EA), eV:	-8.81(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-(2-hydroxyethyl)-4-(5-methyl-3,4-dihydropyrazol-2-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CNC2=CC(=CC=C2)N3C(=NN=N3)C)C

DOS

IR

Vibrations