Geometry & MOs

Info

ID:	143084
PubChem CID:	53144042
Reduced:	N2C9H13 (2)
Stoich.:	A2B9C13 (2)
Weight, g/mol:	292.168797
ΔH_f, kcal/mol:	47.79
Dipole, Da:	2.62
IP(EA), eV:	-8.19(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-1-pyridin-3-ylmethanamine

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=C(N(N=C2C)C3=CC=CC=C3)C

DOS

IR

Vibrations