Geometry & MOs

Info

ID:	353461
PubChem CID:	127285020
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	-31.37
Dipole, Da:	3.58
IP(EA), eV:	-8.84(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpyrazol-1-yl)-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)NCC3(CCOCC3)N4CCCC4)C

DOS

IR

Vibrations