Geometry & MOs

Info

ID:	70251
PubChem CID:	48409740
Reduced:	O2N5C17H27 (1)
Stoich.:	A2B5C17D27 (1)
Weight, g/mol:	384.252526
ΔH_f, kcal/mol:	-50.89
Dipole, Da:	1.91
IP(EA), eV:	-8.98(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxyethyl)-3,5-dimethylpyrazol-4-yl]methyl]-4-(piperidin-1-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)CC(=O)NCC2=C(N(N=C2C)CCOC)C

DOS

IR

Vibrations