Geometry & MOs

Info

ID:	73564
PubChem CID:	48418153
Reduced:	O2N4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	362.210661
ΔH_f, kcal/mol:	15.36
Dipole, Da:	4.18
IP(EA), eV:	-8.88(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-3-phenylpropyl]-3-(3-methylpyrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1)C2=CC=CC(=C2)C(=O)NCC(C3=CC=CO3)N(C)C

DOS

IR

Vibrations