Geometry & MOs

Info

ID:	347284
PubChem CID:	127272078
Reduced:	O2N3C23H35 (1)
Stoich.:	A2B3C23D35 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-104.63
Dipole, Da:	5.31
IP(EA), eV:	-8.69(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC(C1)C(=O)NCC2=CC(=CC=C2)CN3CCC(CC3)C

DOS

IR

Vibrations