Geometry & MOs

Info

ID:	346631
PubChem CID:	127271135
Reduced:	NSO4C19H27 (1)
Stoich.:	ABC4D19E27 (1)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-172.51
Dipole, Da:	5.53
IP(EA), eV:	-9.8(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-1-methyl-N-[1-(oxolan-2-yl)propan-2-yl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C3CCCC3

DOS

IR

Vibrations