Geometry & MOs

Info

ID:	345273
PubChem CID:	127269431
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	342.169191
ΔH_f, kcal/mol:	-38.12
Dipole, Da:	2.98
IP(EA), eV:	-8.9(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C=N2)CC(=O)NCC3CCN(C3)C4CC4

DOS

IR

Vibrations